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Substance Name: 2,4-Dimethyl-1H-1,5-benzodiazepine
RN: 1131-47-1
InChIKey: GRSQZGQYBQLHAW-UHFFFAOYSA-N

Molecular Formula

  • C11-H12-N2

Molecular Weight

  • 172.2298
 
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Names and Synonyms

  • 2,4-Dimethyl-1H-1,5-benzodiazepine

Registry Numbers

CAS Registry Number

  • 1131-47-1

System Generated Number

  • 0001131471

Structure Descriptors

InChI

1S/C11H12N2/c1-8-7-9(2)13-11-6-4-3-5-10(11)12-8/h3-7,12H,1-2H3

InChIKey

GRSQZGQYBQLHAW-UHFFFAOYSA-N

Smiles

N1=C(C=C(Nc2c1cccc2)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.690 (none)   EST
Water Solubility 7400 mg/L 20 EXP
Atmospheric OH Rate Constant 3.09E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.